Compound Identification
SMILES
NC1=C(C#N)C2CCCCCCCN2C(=S)N1C1=CC=CC=C1
InChIKey
InChIKey=ZLYSIPJQHKXLDE-UHFFFAOYSA-N
Formula
C18H22N4S
Mass
326.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylthioureas
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
N-phenylthioureas
Intermediate Tree Nodes
Not available
Direct Parent
N-phenylthioureas
Alternative Parents
Pyrimidinethiones 2-Thiopyrimidines Hydropyrimidines Thioureas Ketene acetals Nitriles Azacyclic compounds Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-phenylthiourea - 2-thiopyrimidine - Pyrimidinethione - Thiopyrimidine - Hydropyrimidine - 1,2,3,4-tetrahydropyrimidine - Pyrimidine - Thiourea - Ketene acetal or derivatives - Nitrile - Carbonitrile - Organoheterocyclic compound - Azacycle - Organopnictogen compound - Organosulfur compound - Organonitrogen compound - Organic nitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-phenylthioureas. These are compounds containing a N-phenylthiourea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a thiourea group.
External Descriptors
Not available